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Merck
CN

SML0457

AE9C90CB

≥98% (HPLC)

Synonym(s):

N-[(1a,5a,6a)-3-Azabicyclo[3.1.0]hex-6-ylmethyl]-a-hydroxy-N-methyl-a-phenyl-benzeneacetamide hydrochloride (1:1)

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About This Item

Empirical Formula (Hill Notation):
C21H24N2O2 · HCl
CAS Number:
893426-98-7
Molecular Weight:
372.89
UNSPSC Code:
12352200
PubChem Substance ID:
329824736
NACRES:
NA.77

Key Documents

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SMILES string

Cl.CN(C[C@@H]1[C@H]2CNC[C@@H]12)C(=O)C(O)(c3ccccc3)c4ccccc4

InChI

1S/C21H24N2O2.ClH/c1-23(14-19-17-12-22-13-18(17)19)20(24)21(25,15-8-4-2-5-9-15)16-10-6-3-7-11-16;/h2-11,17-19,22,25H,12-14H2,1H3;1H/t17-,18+,19+;

InChI key

YHBAWCACDJQGDL-MSFHQNQXSA-N

assay

≥98% (HPLC)

form

powder

color

white to beige

solubility

H2O: 15 mg/mL (clear solution)

storage temp.

2-8°C

Biochem/physiol Actions

AE9C90CB is a muscarinic acetylcholine receptor antagonist with 20-fold selectivity for M3 receptor subtypes compared to M2. In an in vivo assay, AE9C90CB was approximately 5 times more selective for inhibiting carbachol-induced urinary bladder contraction, compared to saliva production.
AE9C90CB is a tissue specific M3 muscarinic receptor antagonist.

Features and Benefits

This compound is featured on the Acetylcholine Receptors (Muscarinic) page of the Handbook of Receptor Classification and Signal Transduction. To browse other handbook pages, click here.

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
082M4617V

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Articles

Muscarinic Acetylcholine Receptors

Muscarinic acetylcholine receptors mediate acetylcholine actions in CNS and non-nervous tissues, crucial for cell signaling.

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